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Bioactive-Guided Phytochemical Investigations, In Vitro and In Silico Alpha-Glucosidase Inhibition of Two Vietnamese Medicinal Plants Dicranopteris linearis and Psychotria adenophylla .

Thuc-Huy DuongY Thien VuNguyen Phuoc LongNguyen-Hong-Nhi PhanNguyen-Kim-Tuyen PhamJirapast SichaemNguyen-Khanh-Duy KieuChi-Bao DuongThanh-Trung NguyenVan-Son DangHuy Truong Nguyen
Published in: Pharmaceuticals (Basel, Switzerland) (2023)
Little is known about the chemical and biological profiles of Dicranopteris linearis and Psychotria adenophylla . No previous studies have investigated alpha-glucosidase inhibition using extracts from D. linearis and P. adenophylla . In this paper, bioactive-guided isolation procedures were applied to the plants D. linearis and P. adenophylla based on alpha-glucosidase inhibition. From the most active fractions, 20 compounds ( DL1 - DL13 and PA1 - PA7 ) were isolated. The chemical structures were elucidated using spectroscopic data and compared with those available in the literature. These compounds were evaluated for alpha-glucosidase inhibition, while a molecular docking study was performed to elucidate the mechanisms involved. Consequently, D. linearis and P. adenophylla might serve as a good potential for developing new antidiabetic preparations.
Keyphrases
  • molecular docking
  • molecular dynamics simulations
  • big data
  • risk assessment
  • deep learning
  • atomic force microscopy